CID 12370445

2411591-27-8

Structural Information

Molecular Formula
C10H13NO
SMILES
COC1=CC2=C(C=C1)[C@@H](CC2)N
InChI
InChI=1S/C10H13NO/c1-12-8-3-4-9-7(6-8)2-5-10(9)11/h3-4,6,10H,2,5,11H2,1H3/t10-/m1/s1
InChIKey
BIYHMCGHGLLTIN-SNVBAGLBSA-N
Compound name
(1R)-5-methoxy-2,3-dihydro-1H-inden-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

163.09972 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.10700 133.1
[M+Na]+ 186.08894 141.5
[M-H]- 162.09244 137.5
[M+NH4]+ 181.13354 156.6
[M+K]+ 202.06288 138.9
[M+H-H2O]+ 146.09698 127.9
[M+HCOO]- 208.09792 157.2
[M+CH3COO]- 222.11357 180.5
[M+Na-2H]- 184.07439 138.6
[M]+ 163.09917 132.0
[M]- 163.10027 132.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.